| SpectraBase Compound ID | 1UUmEJKG0Wb |
|---|---|
| InChI | InChI=1S/C14H10N4O/c1-19-14-11(8-16)12(9-5-3-2-4-6-9)10(7-15)13(17)18-14/h2-6H,1H3,(H2,17,18) |
| InChIKey | BAFCFUMDNJOFHH-UHFFFAOYSA-N |
| Mol Weight | 250.26 g/mol |
| Molecular Formula | C14H10N4O |
| Exact Mass | 250.085461 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9DDpuSYS76A |
|---|---|
| Name | 2-Amino-6-methoxy-4-phenyl-3,5-pyridinedicarbonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.085460957 u |
| Formula | C14H10N4O |
| InChI | InChI=1S/C14H10N4O/c1-19-14-11(8-16)12(9-5-3-2-4-6-9)10(7-15)13(17)18-14/h2-6H,1H3,(H2,17,18) |
| InChIKey | BAFCFUMDNJOFHH-UHFFFAOYSA-N |
| Molecular Weight | 250.261 g/mol |
| SMILES | C1(N)=NC(=C(C(=C1C#N)C1=CC=CC=C1)C#N)OC |